2,2,2-Trifluoro-N-[(3-{[4-(2-{3-[(2-thienylacetyl)amino]phenyl}-pyrazolo[1,5-a]pyridin-3-yl)-2-pyrimidinyl]amino}phenyl)methyl]acetamide

HCID 57737203
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Basic information

Standard SMILES
O=C(Cc1cccs1)Nc1cccc(-c2nn3ccccc3c2-c2ccnc(Nc3cccc(CNC(=O)C(F)(F)F)c3)n2)c1
InChIKey
PFBYNSJICNWTJT-UHFFFAOYSA-N
Molecular formula
C32H24F3N7O2S
Average molar mass
627.6 g/mol
Monoisotopic mass
627.16642869

Names & identifiers

Preferred name
2,2,2-Trifluoro-N-[(3-{[4-(2-{3-[(2-thienylacetyl)amino]phenyl}-pyrazolo[1,5-a]pyridin-3-yl)-2-pyrimidinyl]amino}phenyl)methyl]acetamide
IUPAC
2,2,2-trifluoro-N-[[3-[[4-[2-[3-[(2-thiophen-2-ylacetyl)amino]phenyl]pyrazolo[1,5-a]pyridin-3-yl]pyrimidin-2-yl]amino]phenyl]methyl]acetamide

Names & synonyms

2,2,2-Trifluoro-N-[(3-{[4-(2-{3-[(2-thienylacetyl)amino]phenyl}-pyrazolo[1,5-a]pyridin-3-yl)-2-pyrimidinyl]amino}phenyl)methyl]acetamideSCHEMBL3535687

Database identifiers

PubChem CID
57737203

Properties

Computed structural properties

XLogP
5.3
Topological polar surface area
142 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
10
Rotatable bonds
9
Heavy atoms
45

Related reactions

4 records
New reaction record

Compound notes

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